7-cyclohexyl-6-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid

Systemtic Name: 7-cyclohexyl-6-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Openeye Name: 7-cyclohexyl-6-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid CAS Name: 7-cyclohexyl-6-(3,4-dimethoxyphenyl)-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 7-cyclohexyl-6-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Traditional Name: 7-cyclohexyl-6-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N3C(=C(C=N3)C(=O)O)N=C2)C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N3C(=C(C=N3)C(=O)O)N=C2)C4CCCCC4)OC

InChI

InChI=1S/C21H23N3O4/c1-27-17-9-8-14(10-18(17)28-2)15-11-22-20-16(21(25)26)12-23-24(20)19(15)13-6-4-3-5-7-13/h8-13H,3-7H2,1-2H3,(H,25,26)